5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol

SpectraBase Compound ID	DRoVc8tRobI
InChI	InChI=1S/C15H16ClN5S/c1-9-5-4-6-12(7-9)21-13(17-18-15(21)22)8-20-11(3)14(16)10(2)19-20/h4-7H,8H2,1-3H3,(H,18,22)
InChIKey	VXFHUSWCGIDOEM-UHFFFAOYSA-N Google Search
Mol Weight	333.84 g/mol
Molecular Formula	C15H16ClN5S
Exact Mass	333.081494 g/mol

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SpectraBase Spectrum ID	D9w4nQBrbHe
Name	5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C15H16ClN5S/c1-9-5-4-6-12(7-9)21-13(17-18-15(21)22)8-20-11(3)14(16)10(2)19-20/h4-7H,8H2,1-3H3,(H,18,22)
InChIKey	VXFHUSWCGIDOEM-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_14779
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: UZI/1020166; UBI_ID: UBI-014782
Synonyms	5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature	308 °C